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68433-80-7 | 6,8-Methanoquinoline, 5,6,7,8-tetrahydro-2,7,7-trimethyl-, (6R,8R)-
CAS No: 68433-80-7 Catalog No: AG006JU9 MDL No:
Product Description
Catalog Number:
AG006JU9
Chemical Name:
6,8-Methanoquinoline, 5,6,7,8-tetrahydro-2,7,7-trimethyl-, (6R,8R)-
CAS Number:
68433-80-7
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
IUPAC Name:
(1R,9R)-4,10,10-trimethyl-3-azatricyclo[7.1.1.02,7]undeca-2(7),3,5-triene
InChI:
InChI=1S/C13H17N/c1-8-4-5-9-6-10-7-11(12(9)14-8)13(10,2)3/h4-5,10-11H,6-7H2,1-3H3/t10-,11-/m0/s1
InChI Key:
AYXYIMARQINAPX-QWRGUYRKSA-N
SMILES:
Cc1ccc2c(n1)[C@@H]1C[C@H](C2)C1(C)C
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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